# Bonding information for index 449 -- PRO_2@O 0VA_13@H3O 0VA_13@O3 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 ## Starting information for simulation # 2 449 2 2581 2 2.78 2.6097 12.251 449 2 3279 2 2.82 2.5000 12.724 449 2 3350 2 2.78 2.5239 12.730 449 2 3562 2 2.77 2.6230 11.405 449 2 4663 2 2.96 2.1882 11.101 449 2 6693 2 2.87 2.6171 12.004 449 2 7225 2 2.86 2.7837 11.835 449 2 7240 2 2.95 2.5947 12.837 ## Starting information for simulation # 3 449 3 745 2 2.79 2.6037 11.480 449 3 1398 2 2.85 2.2308 10.732 449 3 1822 2 2.90 2.2958 11.522 449 3 2506 2 2.76 2.4473 11.730 449 3 7458 2 2.93 2.9545 12.720 ## Starting information for simulation # 4 ## Starting information for simulation # 5 ## Starting information for simulation # 6 ## Starting information for simulation # 7 ## Starting information for simulation # 8 ## Starting information for simulation # 9 ## Starting information for simulation # 10 449 10 1115 2 2.83 2.6993 12.937 449 10 1146 2 2.73 2.6457 13.393 449 10 1147 2 2.70 2.8073 12.783 449 10 1171 2 2.81 2.5688 13.658 449 10 1172 2 2.80 2.5596 13.528 449 10 1174 2 2.69 2.8226 13.969 449 10 1175 2 2.57 3.0146 14.096 449 10 1176 2 2.64 2.8259 13.007 449 10 1177 2 2.76 2.9050 13.536 449 10 1179 2 2.83 2.8997 13.618 449 10 1185 2 2.92 2.3243 13.607 449 10 1186 2 2.91 2.1402 13.017 449 10 1188 2 2.79 2.7045 13.523 449 10 1189 2 2.61 2.5497 12.736 449 10 1190 2 2.62 2.6741 13.207 449 10 1191 2 2.63 2.7103 12.999 449 10 1193 2 2.71 2.8665 12.479 449 10 1194 2 2.74 2.9177 13.241 449 10 1195 2 2.76 2.7602 13.134 449 10 1196 2 2.69 2.7125 13.056 449 10 1197 2 2.59 3.0137 13.100 449 10 1198 2 2.69 3.0358 12.466 449 10 1200 2 2.88 3.0803 13.129 449 10 1201 2 2.74 3.0244 13.763 449 10 1202 2 2.92 2.6038 13.363 449 10 1203 2 2.78 2.7766 13.965 449 10 1204 2 2.98 2.8958 14.429 449 10 1206 2 2.73 3.0029 13.148 449 10 1207 2 2.85 2.7322 13.287 449 10 1208 2 2.83 2.7298 13.490 449 10 1209 2 2.67 2.8860 13.610 449 10 1212 2 2.76 2.5966 13.177 449 10 1217 2 2.63 2.8122 13.287 449 10 1218 2 2.89 2.7933 13.250 449 10 1219 2 2.80 2.9077 13.214 449 10 1220 2 2.78 2.8169 13.281 449 10 1221 2 2.95 2.7210 13.218 449 10 1223 2 2.83 2.9434 12.746 449 10 1224 2 2.84 2.3166 12.736 449 10 1226 2 2.68 3.0114 13.158 449 10 1227 2 2.90 3.0142 13.339 449 10 1228 2 2.62 2.9977 13.387 449 10 1229 2 2.61 2.9763 12.751 449 10 1230 2 2.65 2.9235 13.024 449 10 1231 2 2.71 2.7063 13.577 449 10 1232 2 2.81 2.8949 13.267 449 10 1233 2 2.73 2.6971 13.444 449 10 1234 2 2.88 2.5695 13.177 449 10 1235 2 2.67 2.7855 13.238 449 10 1236 2 2.62 2.9245 13.737 449 10 1237 2 2.64 2.8607 13.013 449 10 1238 2 2.84 2.7827 13.477 449 10 1239 2 2.84 2.9306 13.586 449 10 1240 2 2.72 2.6972 13.135 449 10 1241 2 2.94 2.7660 13.673 449 10 1242 2 2.46 2.7842 13.435 449 10 1243 2 2.68 3.0533 13.494 449 10 1245 2 2.80 2.9583 13.640 449 10 1246 2 2.75 2.8238 13.496 449 10 1247 2 2.87 2.8338 13.496 449 10 1248 2 2.62 3.0144 13.219 449 10 1249 2 2.66 2.8005 13.275 449 10 1250 2 2.63 2.9807 13.139 449 10 1251 2 2.93 2.5284 13.427 449 10 1252 2 2.75 2.8905 13.280 449 10 1253 2 2.71 2.9045 13.695 449 10 1254 2 2.76 2.5904 12.699 449 10 1255 2 2.85 2.7843 13.477 449 10 1258 2 2.99 3.0323 13.292 449 10 1259 2 2.66 2.6875 13.474 449 10 1260 2 2.79 2.9012 13.310 449 10 1261 2 2.90 2.8389 12.814 449 10 1262 2 2.83 2.7781 13.225 449 10 1263 2 2.85 2.5147 13.271 449 10 1265 2 2.88 2.9754 13.280 449 10 1266 2 2.60 2.6686 13.681 449 10 1267 2 2.88 3.1068 13.041 449 10 1268 2 3.00 2.6550 13.457 449 10 1270 2 2.88 2.9385 13.230 449 10 1271 2 2.87 2.5872 13.586 449 10 1272 2 2.78 3.0967 13.651 449 10 1273 2 2.90 2.9442 13.739 449 10 1274 2 2.84 3.0044 13.221 449 10 1275 2 2.57 3.0676 13.351 449 10 1276 2 2.80 2.9791 13.522 449 10 1286 2 2.75 2.7995 12.887 449 10 1288 2 2.85 2.7109 13.057 449 10 1290 2 2.68 2.7819 13.107 449 10 1291 2 2.57 2.7015 13.155 449 10 1292 2 2.66 2.6475 13.313 449 10 1293 2 2.80 3.0036 13.330 449 10 1294 2 2.53 2.7476 13.731 449 10 1298 2 2.60 2.7309 13.557 449 10 1299 2 2.92 2.8291 13.585 449 10 1300 2 2.78 2.8779 12.942 449 10 1301 2 2.80 2.9385 13.418 449 10 1302 2 2.93 2.7653 13.789 449 10 1305 2 2.91 2.9603 13.663 449 10 1306 2 2.80 2.9224 13.448 449 10 1309 2 2.75 3.0216 13.269 449 10 1310 2 2.91 3.0094 13.303 449 10 1311 2 2.79 2.8970 13.253 449 10 1312 2 2.66 2.6621 13.074 449 10 1314 2 2.67 2.9030 13.433 449 10 1315 2 2.64 2.9719 12.735 449 10 1316 2 2.91 2.5544 13.093 449 10 1317 2 2.46 3.0649 13.001 449 10 1318 2 2.70 2.7693 12.781 449 10 1319 2 2.69 2.6006 12.492 449 10 1321 2 2.72 2.8181 13.034 449 10 1322 2 2.70 2.6548 13.662 449 10 1323 2 2.70 2.9498 13.580 449 10 1325 2 2.82 3.0200 13.512 449 10 1326 2 2.83 2.7112 13.612 449 10 1327 2 2.84 2.8950 13.320 449 10 1328 2 2.66 2.8651 13.792 449 10 1329 2 2.78 2.7094 13.979 449 10 1330 2 2.87 2.7670 13.245 449 10 1331 2 2.81 2.9765 13.161 449 10 1332 2 2.72 2.8920 13.807 449 10 1333 2 2.67 3.0604 13.528 449 10 1334 2 2.82 2.9950 13.459 449 10 1335 2 2.71 2.8349 13.250 449 10 1336 2 2.80 3.0498 13.476 449 10 1337 2 2.94 3.1341 13.820 449 10 1338 2 2.82 2.2650 13.345 449 10 1339 2 2.69 2.7272 13.514 449 10 1341 2 2.79 2.9883 13.490 449 10 1342 2 2.85 2.8897 13.233 449 10 1358 2 2.83 3.0950 13.352 449 10 1363 2 2.70 2.9301 13.418 449 10 1366 2 2.76 2.6325 13.776 449 10 1371 2 2.95 2.3695 13.610 449 10 1389 2 2.82 2.8431 12.631 449 10 1398 2 2.71 2.8977 13.347 449 10 1413 2 2.58 3.0392 12.523 449 10 1414 2 2.72 2.5797 12.788 449 10 1418 2 2.92 2.8434 12.800 449 10 1419 2 2.83 2.8336 12.743 449 10 1420 2 2.72 2.7345 12.452 449 10 1421 2 2.70 2.7901 13.004 449 10 1422 2 2.91 2.6269 12.679 449 10 1423 2 2.60 2.8495 12.813 449 10 1424 2 2.61 2.9399 12.753 449 10 1425 2 2.58 2.7632 13.068 449 10 1426 2 2.70 3.0702 13.323 449 10 1427 2 2.70 2.7458 13.332 449 10 1428 2 2.74 2.5813 13.481 449 10 1429 2 2.91 2.8940 12.820 449 10 1430 2 2.85 2.8770 12.949 449 10 1431 2 2.72 2.8344 12.868 449 10 1432 2 2.67 3.0648 12.899 449 10 1434 2 2.63 3.0576 12.576 449 10 1435 2 2.93 2.9599 12.712 449 10 1436 2 2.60 2.9187 12.563 449 10 1438 2 2.61 2.5641 13.183 449 10 1439 2 2.57 2.8404 13.070 449 10 1440 2 2.75 3.0930 12.901 449 10 1442 2 2.75 2.9205 13.544 449 10 1443 2 2.99 2.8316 13.247 449 10 1444 2 2.80 2.6043 13.184 449 10 1445 2 2.75 2.8600 13.214 449 10 1446 2 2.68 2.6029 13.785 449 10 1447 2 2.69 2.2843 12.946 449 10 1448 2 2.70 2.9452 13.385 449 10 1450 2 2.75 2.9382 13.061 449 10 1451 2 2.89 3.1154 12.544 449 10 1452 2 2.79 2.6381 13.024 449 10 1453 2 2.72 2.8021 13.637 449 10 1669 2 2.97 2.5986 13.659 449 10 7120 2 2.81 2.3462 11.280 449 10 7301 2 2.99 2.4754 11.675 449 10 9552 2 2.97 2.3855 11.341 ## Starting information for simulation # 11 449 11 3911 2 2.79 2.7183 12.487 ## Starting information for simulation # 12 ## Starting information for simulation # 13 449 13 3832 2 2.83 2.5025 10.129 449 13 4295 2 2.96 2.1716 8.939 449 13 5125 2 2.87 2.5827 9.698 449 13 5139 2 2.83 2.8890 10.074 449 13 8275 2 2.92 2.4917 12.295 449 13 8894 2 2.96 2.1719 11.859 449 13 11805 2 2.82 2.8917 11.654 ## Starting information for simulation # 14 ## Starting information for simulation # 15 ## Starting information for simulation # 16 ## Starting information for simulation # 17 ## Starting information for simulation # 18 449 18 930 2 2.58 2.8391 12.950 449 18 931 2 2.69 2.4038 12.629 449 18 959 2 2.95 2.8050 13.201 449 18 960 2 2.99 2.4829 12.793 449 18 974 2 2.98 2.8373 12.827 449 18 975 2 2.63 2.7830 13.041 449 18 977 2 2.82 3.0845 13.116 449 18 993 2 2.88 2.7572 13.677 449 18 994 2 2.76 2.7912 13.499 449 18 995 2 2.83 2.4254 13.499 449 18 996 2 2.85 3.0698 13.443 449 18 998 2 2.63 2.5856 13.420 449 18 999 2 2.55 2.9052 13.186 449 18 1000 2 2.84 2.7195 13.102 449 18 1001 2 2.64 2.6575 13.085 449 18 1002 2 2.94 2.8097 13.510 449 18 1043 2 2.68 2.8052 13.290 449 18 1044 2 2.72 2.7283 13.322 449 18 1045 2 2.69 2.7171 12.512 449 18 1046 2 2.91 2.8888 13.074 449 18 1047 2 2.57 2.9419 13.322 449 18 1048 2 2.84 2.5064 12.826 449 18 1049 2 2.97 3.0015 13.581 449 18 1050 2 2.72 2.9168 13.136 449 18 1051 2 2.68 2.8672 13.170 449 18 1052 2 2.75 3.0494 13.089 449 18 1054 2 2.57 2.3530 13.356 449 18 1060 2 2.93 2.9119 12.900 449 18 1114 2 2.80 2.8846 13.809 449 18 1116 2 2.84 2.8172 13.131 449 18 1118 2 2.57 2.6203 12.649 449 18 1119 2 2.71 2.8778 13.078 449 18 1120 2 2.70 2.7428 13.047 449 18 1195 2 2.90 2.4978 13.135 449 18 1198 2 2.88 2.5111 12.470 449 18 1199 2 2.70 2.8141 12.414 449 18 8350 2 2.84 2.4685 10.795 449 18 8403 2 2.87 2.5622 11.054 449 18 8410 2 2.82 2.2034 10.970 ## Starting information for simulation # 19 449 19 7083 2 2.75 2.5220 11.727 ## Starting information for simulation # 20 ## Starting information for simulation # 21 ## Starting information for simulation # 22 ## Starting information for simulation # 23 ## Starting information for simulation # 24 449 24 8944 2 2.79 2.7903 12.973 449 24 8979 2 2.53 2.9726 11.655 ## Starting information for simulation # 25 ## Starting information for simulation # 26 ## Starting information for simulation # 27 449 27 7109 2 2.95 2.2337 11.671 449 27 7114 2 2.96 2.1915 11.502 449 27 7116 2 2.78 2.4791 11.524 ## Starting information for simulation # 28 ## Starting information for simulation # 29 449 29 7266 2 2.94 2.2434 11.505 449 29 9832 2 2.73 2.4000 12.413 ## Starting information for simulation # 30 ## Starting information for simulation # 31 ## Starting information for simulation # 32